Area 51 » user205368
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Dec 18 |
awarded | ● Nice Question |
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Dec 11 |
awarded | ● Nice Question |
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Nov 14 |
awarded | ● Nice Question |
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Oct 4 |
awarded | ● Centrist |
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Aug 27 |
proposed question | Matter Modeling: Can someone explain how the COSMO (Conductor-like Screening Model) works and how to properly apply it? I can use MOLCAS, Turbomole, MOLPRO, or ORCA. |
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Aug 27 |
proposed question | Matter Modeling: Can we force CFOUR to cache T3 and T4 amplitudes in the NCC module? I'm modeling the material graphene. |
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Aug 27 |
proposed question | Matter Modeling: Has ML (Machine Learning) had any success in predicting materials with a desired functionality? |
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Aug 27 |
proposed question | Matter Modeling: Why does 'wfn_return' give the same result for SCF and MP2 in Psi4? I am modeling the material graphene. |
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Aug 27 |
proposed question | Matter Modeling: Is the PBC (materials) module in PySCF able to do anything that no other program can do? |
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Aug 27 |
awarded | ● Pioneer |
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Aug 27 |
awarded | ● Advocate |
